%chk=000299260.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299260

0 1
O -0.351329 1.412426 -2.981320
O -0.514885 -0.713578 -3.682801
O -0.471878 3.374968 -1.898440
O 3.667834 1.015345 0.962933
C -1.377023 -1.083270 -0.633132
C -1.303241 1.356087 0.424456
C -1.806482 0.019430 -1.685748
C -1.784464 1.433424 -1.066481
C 0.008837 -0.685422 -0.113739
C 0.043491 0.619033 0.382794
C -2.325671 -0.890116 0.553780
C -2.282437 0.410086 1.119860
C -1.536953 -2.434215 -1.311996
C -1.260118 2.745715 1.043008
C -0.855340 0.088408 -2.868591
C -0.831051 2.236770 -1.939846
C 1.206749 -1.476372 -0.092003
C 1.244205 1.249867 0.773490
C -3.166067 -1.856888 1.091710
C -3.082021 0.724571 2.211735
C 2.435704 -0.845562 0.259779
C 2.420504 0.534900 0.672173
C -3.972471 -1.534203 2.196088
C -3.931467 -0.256597 2.749962
C 1.268970 -2.880129 -0.363834
C 3.666211 -1.568868 0.227394
C 2.459649 -3.565527 -0.375801
C 3.685104 -2.901930 -0.096754
C 3.804240 2.435216 1.312372
C 5.300744 2.600687 1.479082
H -2.827011 -0.234745 -2.058131
H -2.792882 1.908225 -1.095578
H -1.254124 -3.264004 -0.645469
H -2.570093 -2.613198 -1.632806
H -0.906084 -2.512112 -2.214455
H -0.883171 2.714677 2.073309
H -0.610044 3.428467 0.472757
H -2.252671 3.212145 1.068336
H 1.228109 2.273961 1.128459
H -3.205677 -2.862204 0.676865
H -3.057438 1.715276 2.661405
H -4.629144 -2.292509 2.619955
H -4.556429 -0.012531 3.607611
H 0.343506 -3.431845 -0.537691
H 4.585160 -1.029599 0.471870
H 2.479938 -4.633545 -0.593305
H 4.616447 -3.461846 -0.133622
H 3.393930 3.037874 0.483219
H 3.243741 2.614121 2.245417
H 5.560589 3.631764 1.745919
H 5.693471 1.936505 2.261669
H 5.836135 2.345469 0.553038


%chk=000299260-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000299260

0 1
O -0.396863 1.206950 -3.126298
O -0.758925 -1.007954 -3.740180
O -0.522697 3.298099 -2.116293
O 3.721836 0.996589 1.085022
C -1.416927 -1.150807 -0.600362
C -1.260072 1.365481 0.345109
C -1.881674 -0.079300 -1.696425
C -1.800864 1.366413 -1.152929
C 0.028602 -0.725617 -0.190347
C 0.078025 0.599727 0.297915
C -2.324069 -0.858956 0.616117
C -2.247435 0.469805 1.108269
C -1.682022 -2.560487 -1.162970
C -1.180825 2.794616 0.904057
C -0.991760 -0.096439 -2.942335
C -0.871151 2.113570 -2.112638
C 1.259230 -1.493993 -0.246515
C 1.288093 1.210427 0.725607
C -3.180669 -1.788825 1.239233
C -3.023033 0.864188 2.215920
C 2.496916 -0.872580 0.206241
C 2.481517 0.487329 0.683336
C -3.955066 -1.396020 2.358205
C -3.877978 -0.073248 2.845066
C 1.371918 -2.847970 -0.724391
C 3.732782 -1.594424 0.176581
C 2.588803 -3.532366 -0.744421
C 3.786201 -2.907635 -0.288371
C 3.784449 2.404075 1.530219
C 5.243813 2.698983 1.864535
H -2.907504 -0.350658 -2.003705
H -2.781855 1.873765 -1.156215
H -1.425579 -3.346693 -0.433305
H -2.759828 -2.659255 -1.391164
H -1.139784 -2.739160 -2.103063
H -0.830593 2.788910 1.951574
H -0.506978 3.428436 0.306276
H -2.177335 3.271392 0.881048
H 1.271026 2.241552 1.080463
H -3.249557 -2.817830 0.874635
H -2.965540 1.886948 2.600847
H -4.612283 -2.123297 2.847653
H -4.475911 0.228816 3.712049
H 0.493774 -3.369532 -1.093249
H 4.633353 -1.083319 0.526033
H 2.620697 -4.560939 -1.121001
H 4.736030 -3.452403 -0.309628
H 3.414991 3.060132 0.715968
H 3.132118 2.535999 2.417872
H 5.348917 3.745168 2.204705
H 5.603757 2.032421 2.666789
H 5.883532 2.554519 0.977364


